(E)-3-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[3-methoxy-4-(1-naphthylmethoxy)phenyl]-2-(3-nitrobenzoyl)prop-2-enenitrile CAS Name: (E)-3-[3-methoxy-4-(1-naphthalenylmethoxy)phenyl]-2-[(3-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[3-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]-2-(3-nitrobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[3-methoxy-4-(1-naphthylmethoxy)phenyl]-2-(3-nitrobenzoyl)acrylonitrile Formula: C28H20N2O5 MolecularWeight: 464.4688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])OCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)C2=CC(=CC=C2)[N+](=O)[O-])OCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H20N2O5/c1-34-27-15-19(14-23(17-29)28(31)21-8-5-10-24(16-21)30(32)33)12-13-26(27)35-18-22-9-4-7-20-6-2-3-11-25(20)22/h2-16H,18H2,1H3/b23-14+